NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 637 E 4.1541 8.4449 121.4520 56.2514 30.8082 176.7772 638 I 3.8850 7.9252 118.9031 60.2758 37.5705 175.4534 639 A 3.7801 8.1693 126.0687 55.1345 19.2455 178.6013 640 A 4.0015 7.9091 117.0810 54.6596 18.5897 177.9818 641 V 4.3597 7.1822 116.4700 60.1251 30.8296 174.0536 642 P 4.2764 0.0000 0.0000 64.8772 31.7593 178.6959 643 E 4.1864 8.1722 116.4933 58.8434 29.6751 177.6370 644 L 4.4568 8.1695 117.6481 55.5780 42.4630 178.4168 645 A 4.0144 7.9646 121.8821 55.3883 18.0147 179.8606 646 K 3.9435 8.0186 114.9784 60.2612 32.9798 178.4716 647 Y 4.2182 7.9699 117.5001 60.5528 37.9723 177.6604 648 W 3.7934 8.3793 129.3805 60.4279 30.5541 177.8538 649 A 4.0762 8.0763 119.3557 54.3905 17.9789 178.6008 650 Q 4.5033 7.5547 115.0353 55.8543 29.1714 177.6335 651 R 3.8149 7.3900 121.2141 59.8087 28.7509 178.1684 652 Y 4.4346 7.3321 116.1626 60.3924 38.0126 177.8295 653 R 4.1557 8.0843 119.1614 58.4926 29.8744 178.9839 654 L 4.0100 7.6020 117.9849 55.9233 42.2913 177.1792 655 F 5.0879 8.3166 119.9898 55.5012 41.7166 175.6676 656 S 4.5278 9.6668 121.9397 60.6182 62.9777 175.4608 657 R 4.4987 8.3227 118.6268 55.8583 30.3106 177.7964 658 F 4.0306 8.6968 123.8766 61.7875 39.1768 176.9979 659 D 4.6563 8.3545 116.7341 56.0980 40.8603 176.2794 660 D 4.5732 8.2192 119.4296 54.5873 40.5343 176.7496 661 G 4.0171 7.9797 107.4133 45.4553 0.0000 174.4055 662 I 3.6936 6.8487 119.4221 60.8013 37.5126 175.8928 663 K 4.5801 8.8073 123.2808 54.5690 35.1251 175.8950 664 L 4.5559 8.0368 121.0734 52.2307 45.7313 176.3162 665 D 4.8412 8.1011 121.6265 51.7908 42.7507 177.2875 666 R 3.7201 8.3661 118.0498 59.8577 30.0414 177.8339 667 E 4.0111 8.1548 118.4771 59.0447 29.6072 178.7534 668 G 3.5474 8.4627 106.0416 47.5446 0.0000 175.5360 669 W 4.1650 7.6562 120.3256 59.6963 29.1432 178.4555 670 F 4.3526 7.3807 116.2315 59.6546 38.3942 176.9668 671 S 4.5108 7.6134 112.5029 57.5171 64.5177 175.1412 672 V 3.6108 7.3186 121.7745 61.6151 31.5565 176.1256 673 T 3.9758 8.0691 120.5764 62.4577 69.0166 173.3313 674 P 4.2186 0.0000 0.0000 62.4836 33.2584 177.0453 675 E 3.7087 8.4857 122.1241 59.3135 29.5612 179.4120 676 K 3.9294 7.9659 119.0772 59.4954 32.2341 178.7301 677 I 3.7519 7.6963 119.2974 64.4347 37.1185 178.0541 678 A 3.6592 8.0042 121.7295 54.9766 18.0256 179.2810 679 E 3.7216 8.3912 118.1659 59.5400 29.7122 178.4710 680 H 4.1260 8.3367 118.2597 59.4371 29.9189 177.2998 681 I 3.8408 8.0609 121.5195 64.3808 36.8565 178.2905 682 A 4.2506 8.1448 122.0952 54.9723 18.0719 179.8735 683 G 3.5613 8.2719 104.3618 48.0108 0.0000 176.0527 684 R 3.8494 7.7633 119.5460 58.8344 30.1960 178.9378 685 V 3.8712 7.8451 116.7437 66.2707 31.6673 178.0478 686 S 4.3338 8.2760 112.7640 60.5895 63.4556 174.7374 687 Q 4.4570 7.7399 121.4639 56.7702 28.5376 176.1048 688 S 4.4433 7.8018 115.1799 61.0306 69.3126 174.8716 *691 C 4.3876 7.5733 121.8768 59.9261 28.7414 172.8123 692 D 4.8867 9.5624 121.7385 53.3397 44.3633 175.4353 693 V 4.8382 8.1111 119.0592 60.9542 33.8300 174.3870 694 V 4.7563 8.4750 128.2495 59.8022 34.2306 174.8863 695 V 4.2849 8.5364 124.9289 61.8646 32.6943 174.4289 696 D 5.1493 8.8395 129.4745 53.1143 40.3853 176.3882 697 A 3.5364 8.4862 128.0718 53.6003 18.8885 177.7350 698 F 4.7314 7.8840 113.0461 55.9622 39.7220 174.0835 699 C 4.7257 8.9640 118.7896 57.7716 31.4053 176.3188 700 G 3.6364 8.0137 109.7134 47.4020 0.0000 174.5193 701 V 3.9749 8.3694 117.9811 61.3410 31.5683 177.1154 702 G 4.0251 8.6635 108.5311 45.9484 0.0000 175.9122 703 G 3.6600 8.3510 107.2636 48.1405 0.0000 175.8755 704 N 3.8188 7.7995 118.8279 55.4279 38.6499 177.3836 705 T 3.9784 7.9083 116.7474 67.0501 68.5633 176.3257 706 I 3.6721 7.9323 121.6080 64.4812 36.8284 178.6305 707 Q 3.8549 7.1316 117.2987 58.6700 28.7026 178.3107 708 F 4.4852 7.8879 118.8582 60.6604 38.9459 177.6018 709 A 4.2318 8.2277 120.3418 55.1610 17.9471 179.6592 710 L 4.0347 7.9861 116.8285 57.5079 41.7388 178.8440 711 T 4.3062 7.4809 107.4053 61.9498 69.3187 175.5750 712 G 3.9948 8.0662 110.6267 45.2237 0.0000 173.8528 713 M 4.2978 7.1119 118.7283 55.1597 33.0433 175.8680 714 R 4.4162 9.1325 122.8055 55.6720 31.7767 175.1531 715 V 4.6795 8.3978 126.2650 61.1540 34.5634 174.2988 716 I 4.7042 8.5879 128.5592 59.8047 38.9690 174.2264 717 A 5.0170 8.6141 130.6225 50.3305 20.9334 175.5179 718 I 5.0404 8.7361 123.9031 59.5909 40.6045 174.4111 719 D 4.9578 8.9024 125.1494 52.8538 44.4837 175.9581 720 I 4.0985 8.6011 123.5318 62.0054 38.7395 174.9009 721 D 4.7956 8.4819 121.0065 52.0516 41.7996 174.9212 722 P 4.2871 0.0000 0.0000 65.6739 31.2897 178.6907 723 V 3.5885 8.1720 117.1381 65.8622 31.4146 178.2733 724 K 3.9642 8.0292 118.1194 59.5246 31.8491 179.2264 725 I 3.7221 7.8355 119.3330 64.4830 37.0498 178.1409 726 A 3.8285 7.9807 121.3855 55.0135 18.0896 179.7431 727 L 3.8134 7.9787 117.2520 57.7950 41.7247 179.5133 728 A 4.2378 8.3622 122.4055 54.5946 18.3649 179.6694 729 R 3.2562 7.7834 117.3043 59.2411 30.1588 178.1376 730 N 4.1528 7.9140 116.7777 56.9320 38.9267 176.6163 731 N 4.2000 8.3858 117.8946 56.0723 38.6789 177.2603 732 A 4.1064 8.5478 122.6757 55.2126 18.4530 179.5201 733 E 3.9227 8.1736 117.0081 59.5802 29.3316 179.4421 734 V 3.5445 7.3902 116.8123 66.2938 31.5505 176.8221 735 Y 4.2306 7.7476 112.5370 57.2105 37.8761 175.8664 736 G 4.0350 8.3446 108.3627 46.3823 0.0000 174.1768 737 I 4.6428 7.7509 110.3311 59.9915 38.4862 177.2306 738 A 4.2113 8.3946 127.1397 56.0259 18.3107 180.4288 739 D 4.4924 8.0960 114.1333 56.0501 39.7173 177.4114 740 K 4.2348 8.1383 118.3588 57.2462 32.4917 176.0508 741 I 4.8284 7.4544 119.7264 59.2529 40.0966 174.7786 742 E 4.6028 8.8527 125.5207 54.6836 31.7150 174.9180 743 F 5.1501 8.9310 123.5820 56.2447 40.9503 175.3812 744 I 4.5182 9.0766 124.0127 59.5889 40.3969 174.2473 745 C 4.8714 8.8908 128.6299 59.4379 31.8170 172.3899 746 G 3.9655 8.4999 112.9849 46.3368 0.0000 170.6347 747 D 4.9407 8.0906 119.3842 52.4962 41.3993 176.2532 748 F 4.0666 8.7673 129.8005 61.6031 38.9282 176.7019 749 L 3.7590 8.1040 117.5595 57.1322 41.4937 178.5553 750 L 4.4390 7.7248 116.3506 55.1577 42.5416 177.8809 751 L 4.3624 7.4239 118.3175 56.3292 42.2415 178.1385 752 A 3.6178 7.4445 121.1318 55.3574 17.9661 179.6011 753 S 3.9470 7.5089 110.1065 60.0417 62.7132 174.8503 754 F 4.9534 7.7525 119.0025 56.8272 40.4138 174.3791 755 L 4.7269 7.6662 120.4160 53.1194 43.1543 176.2155 756 K 4.5641 8.0366 119.8206 54.7626 35.2298 175.4950 757 A 4.4557 7.9388 123.2575 51.5507 21.7502 175.8626 758 D 4.6084 8.6827 120.1256 56.6335 41.6973 177.7360 759 V 4.6706 7.5456 116.6475 61.0147 35.6082 174.1702 760 V 4.6380 8.6450 126.9063 61.1058 34.0590 173.7205 761 F 5.1832 9.2622 131.1095 56.6191 41.5526 174.1586 762 L 4.5336 8.1506 126.5721 52.2902 43.8380 176.8461 763 S 4.7204 7.8569 119.4893 56.1661 62.6148 170.9765 764 P 3.5832 0.0000 0.0000 61.5267 32.4450 174.8555 765 P 4.2266 0.0000 0.0000 62.6892 31.5300 176.8851 766 W 4.8916 8.3011 120.9946 56.2531 30.1229 176.4866 767 G 4.1962 8.7132 107.7721 45.7435 0.0000 174.8766 768 G 4.0330 8.5283 109.0239 43.4436 0.0000 173.5023 769 P 4.5652 0.0000 0.0000 64.6274 31.4478 177.4669 770 D 4.5389 8.0773 118.0281 55.7447 41.3184 177.6109 771 Y 4.3269 8.2941 117.4284 60.1088 37.7011 177.3376 772 A 4.0162 6.7595 120.0616 52.2033 18.6342 177.8269 773 T 4.0163 7.8244 108.3412 63.9512 69.4489 175.6807 774 A 4.2193 7.7171 124.1633 51.3352 19.3124 176.8243 775 E 4.0554 8.8983 122.9120 58.7853 30.0206 177.2286 776 T 4.7949 7.5757 113.6310 61.4719 71.6195 173.5579 777 F 4.2997 9.3589 129.5951 57.5508 40.8326 173.8224 778 D 5.1193 8.0175 127.2179 53.1087 41.7292 176.8113 779 I 3.9879 9.0215 120.3822 62.3537 38.1499 177.6717 780 R 4.5167 8.7735 121.7477 57.6100 30.4809 176.6766 781 T 4.4654 7.9400 104.8260 61.5326 70.2308 174.3339 782 M 4.4497 7.8270 119.9618 55.0645 33.0008 175.3209 783 M 4.9285 7.7823 118.3525 53.4065 34.8165 175.0964 784 S 4.6803 8.4943 116.1651 55.8211 65.1093 172.0289 785 P 4.5891 0.0000 0.0000 61.9163 32.1435 176.1383 786 D 4.7725 8.6731 119.3234 54.3976 42.9006 177.4016 787 G 3.9903 9.1504 113.8098 49.0146 0.0000 176.0785 788 F 4.2054 9.3055 120.4606 60.2076 38.9413 177.5094 789 E 4.0405 8.4501 119.2485 59.3375 29.5249 178.7422 790 I 3.9330 8.0911 119.9391 64.5806 37.2289 178.1682 791 F 3.8723 8.2807 120.8811 61.2079 39.0090 177.0648 792 R 3.9546 8.2685 117.4577 59.5454 30.2212 178.2128 793 L 4.0300 8.1293 118.7668 57.8187 41.6026 179.5981 794 S 4.2234 8.1850 115.0901 61.4584 62.4557 176.8623 795 K 4.1725 7.3154 121.5714 58.3994 31.7265 179.1560 796 K 4.0421 7.5141 118.3572 59.0055 31.8942 179.1826 797 I 3.9221 7.3175 119.0310 62.8743 37.6886 175.5551 798 T 4.4661 7.2612 111.7221 61.4415 70.1932 173.4274 799 N 4.5159 8.5199 120.4456 54.2665 39.3952 174.7922 800 N 5.0416 8.0859 116.9873 52.1143 38.4299 173.1716 801 I 4.9893 8.2751 123.3710 59.1303 41.1508 174.2175 802 V 4.8296 8.9412 126.6639 61.2320 34.2423 173.4755 803 Y 5.0854 9.2999 129.2992 55.8853 41.1978 173.8509 804 F 5.1777 9.3779 130.8305 57.2628 40.4156 174.7603 805 L 4.2034 8.2225 125.0467 51.7715 46.7375 174.4125 806 P 3.3649 0.0000 0.0000 61.7696 31.5644 178.2663 807 R 3.7867 8.3031 117.9742 58.3761 29.6363 176.9421 808 N 4.7852 7.7750 115.4916 52.1370 37.8072 174.2835 809 A 4.2832 7.4828 121.6845 52.6677 19.0646 177.8964 810 D 4.3629 8.7192 121.6113 54.3809 41.3753 177.3115 811 I 3.7420 8.3597 128.9664 64.1920 37.1732 177.8060 812 D 4.3904 8.2031 119.4800 57.6391 40.4546 178.9087 813 Q 4.1226 8.2802 116.7635 59.0358 29.2139 178.5580 814 V 3.5283 7.6742 118.9396 66.1404 31.2923 177.9706 815 A 4.0729 8.1955 119.6053 54.8741 18.4991 179.2030 816 S 4.3366 8.1758 112.0148 60.3200 63.1059 176.4147 817 L 3.6045 7.3809 122.1936 57.8242 41.2561 178.1333 818 A 4.2245 8.0340 117.9273 52.2965 18.8458 177.9733 819 G 4.0333 8.1590 104.0667 43.6598 0.0000 171.3938 820 P 4.2661 0.0000 0.0000 64.3520 31.3833 177.3554 821 G 3.9045 9.0467 110.5105 45.5966 0.0000 173.5304 822 G 4.0627 8.0216 108.9029 44.5152 0.0000 173.2376 823 Q 4.7770 8.3504 116.7378 54.0970 31.5293 175.1037 824 V 4.3471 7.9181 117.5918 60.1898 34.7870 173.3987 825 E 4.5669 8.9048 124.5932 54.7615 31.4573 174.3377 826 I 5.0540 8.4312 127.7014 59.4586 39.4396 174.6555 827 E 4.8781 9.3890 125.4063 54.6329 32.6883 174.8223 828 Q 4.7455 8.6884 120.2714 54.8592 30.6464 174.5881 829 N 5.0208 9.2805 122.1074 51.8213 40.6275 174.1500 830 F 5.2957 8.9645 121.3582 55.5536 42.7642 174.7798 831 L 4.5895 8.7624 122.8182 54.1608 43.9998 176.0670 832 N 3.9023 9.8033 125.3888 54.9368 37.2751 174.1429 833 N 4.3592 8.6008 109.8508 53.0612 36.3696 173.8179 834 K 4.6090 7.7768 120.6453 53.9601 33.7375 175.3365 835 L 3.5219 8.7361 128.1909 55.5647 42.3618 174.9973 836 K 4.5966 8.7235 124.6787 57.6634 33.8619 176.3627 837 T 4.5963 7.3094 107.1927 60.7514 72.5026 171.3038 838 I 4.8695 7.9893 114.3266 59.3345 40.9802 174.6572 839 T 5.0758 8.8722 119.6385 61.8247 72.0101 172.6313 840 A 5.0886 9.1394 128.5871 50.4780 21.5355 174.9027 841 Y 5.1901 9.1994 120.5457 56.3250 40.6398 175.2086 842 F 5.2056 9.3962 121.8911 54.8806 43.6283 177.1213 843 G 3.9411 8.8517 107.9261 46.9680 0.0000 175.1050 844 D 4.8326 9.6891 125.3964 54.3451 40.6554 177.0829 845 L 4.3076 7.6679 119.8659 56.2012 42.1031 177.5416 846 I 4.0383 7.1601 119.2191 60.7145 37.6286 176.2759 847 R 4.0571 8.6839 122.8917 56.7230 29.7937 176.5403 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 637 E 8.44 4.15 0.00 1.79 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.00 0.00 638 I 7.93 3.89 1.21 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.66 0.55 0.00 0.00 639 A 8.17 3.78 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 640 A 7.91 4.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 641 V 7.18 4.36 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.89 0.00 0.00 642 P 0.00 4.28 0.00 2.23 2.09 0.00 3.67 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 643 E 8.17 4.19 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 644 L 8.17 4.46 0.00 1.72 1.30 0.59 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 645 A 7.96 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 646 K 8.02 3.94 0.00 1.74 1.89 0.00 0.61 0.00 0.00 1.29 0.00 0.00 2.85 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.27 1.41 7.81 647 Y 7.97 4.22 0.00 3.10 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 648 W 8.38 3.79 0.00 3.02 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 649 A 8.08 4.08 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 Q 7.55 4.50 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 651 R 7.39 3.81 0.00 0.72 1.60 0.00 2.21 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 652 Y 7.33 4.43 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 653 R 8.08 4.16 0.00 2.09 1.99 0.00 3.14 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 654 L 7.60 4.01 0.00 1.76 1.50 1.22 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 655 F 8.32 5.09 0.00 3.32 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 656 S 9.67 4.53 0.00 4.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 657 R 8.32 4.50 0.00 1.38 1.64 0.00 2.86 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 658 F 8.70 4.03 0.00 3.29 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 659 D 8.35 4.66 0.00 2.87 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 660 D 8.22 4.57 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 661 G 7.98 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 662 I 6.85 3.69 1.39 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.66 0.38 0.00 0.00 663 K 8.81 4.58 0.00 1.52 1.57 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 1.51 7.81 664 L 8.04 4.56 0.00 0.59 0.89 0.38 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 665 D 8.10 4.84 0.00 2.94 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 666 R 8.37 3.72 0.00 1.84 1.90 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.20 0.00 743 F 8.93 5.15 0.00 2.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 744 I 9.08 4.52 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.08 0.93 0.00 0.00 745 C 8.89 4.87 0.00 3.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 746 G 8.50 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 747 D 8.09 4.94 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 748 F 8.77 4.07 0.00 2.82 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 749 L 8.10 3.76 0.00 1.76 1.72 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 750 L 7.72 4.44 0.00 1.60 1.72 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 751 L 7.42 4.36 0.00 1.61 1.70 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 752 A 7.44 3.62 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 753 S 7.51 3.95 0.00 2.78 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 754 F 7.75 4.95 0.00 2.97 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 755 L 7.67 4.73 0.00 1.78 1.59 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 756 K 8.04 4.56 0.00 1.69 1.66 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.40 7.81 757 A 7.94 4.46 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 758 D 8.68 4.61 0.00 2.67 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 759 V 7.55 4.67 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.91 0.00 0.00 760 V 8.64 4.64 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.92 0.00 0.00 761 F 9.26 5.18 0.00 3.10 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 762 L 8.15 4.53 0.00 0.93 1.05 0.06 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 763 S 7.86 4.72 0.00 3.95 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 764 P 0.00 3.58 0.00 1.89 1.04 0.00 3.89 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.65 0.00 765 P 0.00 4.23 0.00 2.10 2.00 0.00 3.51 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 766 W 8.30 4.89 0.00 3.03 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 767 G 8.71 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 768 G 8.53 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 769 P 0.00 4.57 0.00 1.90 2.10 0.00 3.38 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.63 0.00 770 D 8.08 4.54 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 771 Y 8.29 4.33 0.00 3.32 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 772 A 6.76 4.02 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 773 T 7.82 4.02 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 774 A 7.72 4.22 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 775 E 8.90 4.06 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 776 T 7.58 4.79 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 777 F 9.36 4.30 0.00 3.22 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 778 D 8.02 5.12 0.00 2.62 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 779 I 9.02 3.99 1.75 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.58 0.83 0.00 0.00 780 R 8.77 4.52 0.00 2.01 2.26 0.00 3.12 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 781 T 7.94 4.47 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 782 M 7.83 4.45 0.00 1.55 1.04 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 783 M 7.78 4.93 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.04 3.00 0.00 784 S 8.49 4.68 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 785 P 0.00 4.59 0.00 2.27 2.12 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.28 0.00 786 D 8.67 4.77 0.00 2.84 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 787 G 9.15 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 788 F 9.31 4.21 0.00 3.42 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 E 8.45 4.04 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 790 I 8.09 3.93 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.08 1.11 0.00 0.00 791 F 8.28 3.87 0.00 3.35 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 792 R 8.27 3.95 0.00 2.07 2.18 0.00 3.34 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 793 L 8.13 4.03 0.00 1.80 1.42 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 794 S 8.19 4.22 0.00 3.61 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 795 K 7.32 4.17 0.00 1.81 1.76 0.00 1.44 0.00 0.00 1.13 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.89 1.34 7.81 796 K 7.51 4.04 0.00 1.77 1.72 0.00 1.48 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.36 7.81 797 I 7.32 3.92 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.38 0.94 0.00 0.00 798 T 7.26 4.47 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 799 N 8.52 4.52 0.00 2.82 2.89 0.00 0.00 6.80 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 800 N 8.09 5.04 0.00 2.89 2.83 0.00 0.00 6.61 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 801 I 8.28 4.99 1.85 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.62 0.72 0.00 0.00 802 V 8.94 4.83 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.17 0.00 0.00 803 Y 9.30 5.09 0.00 3.27 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 804 F 9.38 5.18 0.00 3.05 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 805 L 8.22 4.20 0.00 1.13 0.81 0.28 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 806 P 0.00 3.36 0.00 1.49 1.02 0.00 2.45 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 807 R 8.30 3.79 0.00 1.77 2.03 0.00 2.94 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 808 N 7.78 4.79 0.00 3.02 3.00 0.00 0.00 6.17 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 A 7.48 4.28 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 810 D 8.72 4.36 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 811 I 8.36 3.74 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.69 0.87 0.00 0.00 812 D 8.20 4.39 0.00 2.92 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 813 Q 8.28 4.12 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.91 0.00 0.00 0.00 0.00 0.00 2.65 2.54 0.00 814 V 7.67 3.53 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.80 0.00 0.00 815 A 8.20 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 816 S 8.18 4.34 0.00 4.18 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 817 L 7.38 3.60 0.00 1.42 0.13 0.63 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 818 A 8.03 4.22 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 819 G 8.16 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 820 P 0.00 4.27 0.00 2.08 2.06 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 821 G 9.05 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 G 8.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 823 Q 8.35 4.78 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 824 V 7.92 4.35 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 -0.00 0.00 0.00 825 E 8.90 4.57 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 826 I 8.43 5.05 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.69 0.87 0.00 0.00 827 E 9.39 4.88 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.44 0.00 828 Q 8.69 4.75 0.00 2.02 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 829 N 9.28 5.02 0.00 2.66 2.82 0.00 0.00 6.53 5.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 830 F 8.96 5.30 0.00 2.87 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 831 L 8.76 4.59 0.00 1.70 1.53 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 832 N 9.80 3.90 0.00 2.89 2.87 0.00 0.00 7.33 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 833 N 8.60 4.36 0.00 2.94 2.94 0.00 0.00 6.97 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 834 K 7.78 4.61 0.00 1.85 1.87 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.38 7.81 835 L 8.74 3.52 0.00 1.51 1.51 0.35 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 836 K 8.72 4.60 0.00 1.78 1.85 0.00 1.87 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.55 7.81 837 T 7.31 4.60 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 838 I 7.99 4.87 1.84 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.49 0.73 0.00 0.00 839 T 8.87 5.08 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 840 A 9.14 5.09 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 Y 9.20 5.19 0.00 2.81 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 842 F 9.40 5.21 0.00 3.05 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 843 G 8.85 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 844 D 9.69 4.83 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 845 L 7.67 4.31 0.00 2.00 1.99 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 846 I 7.16 4.04 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.54 0.96 0.00 0.00 847 R 8.68 4.06 0.00 1.77 1.82 0.00 3.11 0.00 0.00 3.60 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.46 0.00 * Residues marked with a * may have inaccurate shift predictions.